2-ethyl-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-ethyl-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-ethyl-6-morpholinosulfonyl-quinoline-4-carboxylic acid CAS Name: 2-ethyl-6-(4-morpholinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-ethyl-6-morpholin-4-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-ethyl-6-morpholinosulfonyl-cinchoninic acid Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=C1)C(=O)O

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=C1)C(=O)O

InChI

InChI=1S/C16H18N2O5S/c1-2-11-9-14(16(19)20)13-10-12(3-4-15(13)17-11)24(21,22)18-5-7-23-8-6-18/h3-4,9-10H,2,5-8H2,1H3,(H,19,20)